Modulating the structures of copper(I) cyanide coordination polymers by rigid bis(imidazole) ligands and solvents: An experimental and theoretical study

Journal of Molecular Structure

Volumn 1036, Issue , 2013, Pages 235-243

  Huang, Rong Yi ^a   Xu, Heng ^a   Ye, Shi Yong ^b   Wu, Gen Hua ^a   Zhao, Xiu Qin ^a   Wang, Yan ^a   Liu, Guang Xiang ^a  

^a ANQING NORMAL UNIVERSITY   (China)

^b ANHUI NORMAL UNIVERSITY   (China)

Author keywords

Bis(imidazole) ligand; Coordination polymer; Copper(I) cyanide; Crystal structures; Quantum chemical calculation

Indexed keywords

3D NETWORKS; 4-FOLD INTERPENETRATIONS; COMPLEX 1; COORDINATION POLYMERS; COPPER CYANIDE; DENSITY FUNCTIONALS; DIFFERENT STRUCTURE; EXTENDED ANALYSIS; HELICAL CHAINS; METAL-LIGAND BONDS; ORGANIC LIGANDS; PRODUCT STRUCTURE; QUANTUM CHEMICAL CALCULATIONS; REACTION SOLVENTS; SOLVOTHERMAL CONDITIONS; SUPRAMOLECULAR STRUCTURE; THEORETICAL CALCULATIONS; THEORETICAL RESULT; THEORETICAL STUDY; ZIGZAG CHAINS;

BENZENE; COMPLEX NETWORKS; COPPER; CRYSTAL STRUCTURE; CYANIDES; IODINE; LIGANDS; POLYMERS; QUANTUM CHEMISTRY; THREE DIMENSIONAL COMPUTER GRAPHICS; TOPOLOGY;

COPPER COMPOUNDS;

EID: 84871365440     PISSN: 00222860     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.molstruc.2012.11.058     Document Type: Article

References (61)

1. B. Zheng, H. Dong, J.F. Bai, Y.Z. Li, S.H. Li, and M. Scheer J. Am. Chem. Soc. 130 2008 7778
2. L. Brammer Chem. Soc. Rev. 33 2004 476
3. M.D. Allendorf, C.A. Bauer, R.K. Bhakta, and R.J.T. Houk Chem. Soc. Rev. 38 2009 133
4. O.M. Yaghi, M. O'Keeffe, N.W. Ockwig, H.K. Chae, M. Eddaoudi, and J. Kim Nature 423 2003 705
5. H. Furukawa, N. Ko, Y.B. Go, N. Aratani, S.B. Choi, E. Choi, A.Ö. Yazaydin, R.Q. Snurr, M. O'Keeffe, J. Kim, and O.M. Yaghi Science 329 2010 424
6. D. Tanaka, A. Henke, K. Albrecht, M. Moeller, K. Nakagawa, and S. Kitagawa J. Groll Nat. Chem. 2 2010 410
7. M.V. Vasylyev, and R. Neumann J. Am. Chem. Soc. 126 2004 884
8. M. Sadakiyo, T. Yamada, and H. Kitagawa J. Am. Chem. Soc. 131 2009 9906
9. L.J. Murray, M. Dincâ, and J.R. Long Chem. Soc. Rev. 38 2009 1294
10. W. Walker, S. Grugeon, O. Mentre, S. Laruelle, J.M. Tarascon, and F. Wudl J. Am. Chem. Soc. 132 2010 6517
11. B.S. Zheng, J.F. Bai, J.G. Duan, L. Wojtas, and M.J. Zaworotko J. Am. Chem. Soc. 133 2011 748
12. M.D. Allendorf, C.A. Bauer, R.K. Bhakta, and R.J.T. Houk Chem. Soc. Rev. 38 2009 1330
13. J. Yang, B. Li, J.F. Ma, Y.Y. Liu, and J.P. Zhang Chem. Commun. 46 2010 8383
14. T.Y. Shvareva, S. Skanthakumar, L. Soderholm, A. Clearfield, and T.E. Albrecht-Schmitt Chem. Mater. 19 2007 132
15. A.J. Blake, N.R. Brooks, N.R. Champness, M. Crew, A. Deveson, D. Fenske, D.H. Gregory, L.R. Hanton, P. Hubberstey, and M. Schröder Chem. Commun. 2001 1432
16. Y.J. Qi, Y.H. Wang, C.W. Hu, M.H. Cao, L. Mao, and E.B. Wang Inorg. Chem. 42 2003 8519
17. V.S.S. Kumar, F.C. Pigge, and N.P. Rath New J. Chem. 28 2004 1192
18. B. Li, G. Li, D. Liu, Y. Peng, X. Zhou, J. Hua, Z. Shi, and S. Peng CrystEngComm 13 2011 1291
19. A.P. Cote, A.I. Benin, N.W. Ockwig, M. O'Keeffe, A.J. Matzger, and O.M. Yaghi Science 310 2005 1166
20. X.Y. Wang, L. Wang, Z.M. Wang, and S. Gao J. Am. Chem. Soc. 128 2006 674
21. S. Hasegawa, S. Horike, R. Matsuda, S. Furukawa, K. Mochiźuki, Y. Kinoshita, and S. Kitagawa J. Am. Chem. Soc. 129 2007 2607
22. R. Vilar Angew. Chem. Int. Ed. 42 2003 1460
23. J.Q. Liu, Y.Y. Wang, and Y.S. Huang CrystEngComm 13 2011 3733
24. Y.B. Zhang, W.X. Wang, F.Y. Feng, J.P. Zhang, and X.M. Chen Angew. Chem. Int. Ed. 48 2009 5287
25. J. Xu, Z.R. Pan, T.W. Wang, Y.Z. Li, Z.J. Guo, S.R. Batten, and H.G. Zheng CrystEngComm 12 2010 612
26. J.Y. Lu Coord. Chem. Rev. 246 2003 327
27. Y. Xu, P.K. Chen, Y.X. Che, and J.M. Zheng Eur. J. Inorg. Chem. 2010 5478
28. J.R. Li, D.J. Timmons, and H.C. Zhou J. Am. Chem. Soc. 131 2009 6368
29. J.C. Jin, Y.N. Zhang, Y.Y. Wang, J.Q. Liu, Z. Dong, and Q.Z. Shi Chem. Asian J. 5 2010 1611
30. E.C. Yang, Z.Y. Liu, X.J. Shi, Q.Q. Liang, and X.J. Zhao Inorg. Chem. 49 2010 7969
31. Y. Qi, Y.X. Che, and J.M. Zheng Cryst. Growth Des. 8 2008 3602
32. G.H. Wei, Y. Yang, J.F. Ma, Y.Y. Liu, S.L. Li, and L.P. Zhang Dalton Trans. 2008 3080
33. L.L. Wen, F. Wang, J. Feng, K.L. Lv, C.G. Wang, and D.F. Li Cryst. Growth Des. 9 2009 3581
34. S. Zhang, S. Yang, J. Lan, Y. Tang, Y. Xue, and J. You J. Am. Chem. Soc. 131 2009 1689
35. G.S. Yang, Y.Q. Lan, H.Y. Zang, K.Z. Shao, X.L. Wang, Z.M. Su, and C.J. Jiang CrystEngComm 11 2009 274
36. Z.X. Li, X. Chu, G.H. Cui, Y. Liu, L. Li, and G.L. Xue CrystEngComm 13 2011 1984
37. G.X. Liu, K. Zhu, H.M. Xu, S. Nishihara, R.Y. Huang, and X.M. Ren CrystEngComm 12 2010 1175
38. G.X. Liu, R.Y. Huang, L.F. Huang, X.J. Kong, and X.M. Ren CrystEngComm 11 2009 643
39. G.X. Liu, K. Zhu, H.M. Xu, S. Nishihara, R.Y. Huang, and X.M. Ren CrystEngComm 11 2009 2784
40. G.X. Liu, K. Zhu, H. Chen, R.Y. Huang, H. Xu, and X.M. Ren Inorg. Chim. Acta 362 2009 1605
41. G.X. Liu, R.Y. Huang, H. Xu, X.J. Kong, L.F. Huang, K. Zhu, and X.M. Ren Polyhedron 27 2008 2327
42. G.X. Liu, K. Zhu, H. Chen, R.Y. Huang, and X.M. Ren CrystEngComm 10 2008 1527
43. J. Fan, G.T. Yee, G.B. Wang, and B.E. Hanson Inorg. Chem. 45 2006 599
44. G.M. Sheldrick SHELXS-97, Program for Crystal Structure Solution 1997 University of Göttingen Germany
45. G.M. Sheldrick SHELXL-97, Program for Crystal Structure Refinement 1997 University of Göttingen Germany
46. J. Xia, Z.J. Zhang, W. Shi, J.F. Wei, and P. Cheng Cryst. Growth Des. 10 2010 2323
47. X.Z. Li, X.P. Zhou, D. Li, and Y.G. Yin CrystEngComm 13 2011 6759
48. Z.H. Su, Z.F. Zhao, B.B. Zhou, Q.H. Cai, and Y. Zhang CrystEngComm 13 2011 1474
49. A.F. Wells Three-Dimensional Nets and Polyhedral 1977 Wiley-Interscience New York
50. V.A. Blatov IUCrCompComm Newsletter 7 2006 4
51. V.A. Blatov, L. Carlucci, G. Ciani, and D.M. Proserpio CrystEngComm 6 2004 377
52. M.J. Frisch, G.W. Trucks, H.B. Schlegel, G.E. Scuseria, M.A. Robb, J.R. Cheeseman, G. Scalmani, V. Barone, B. Mennucci, G.A. Petersson, H. Nakatsuji, M. Caricato, X. Li, H.P. Hratchian, A.F. Izmaylov, J. Bloino, G. Zheng, J.L. Sonnenberg, M. Hada, M. Ehara, K. Toyota, R. Fukuda, J. Hasegawa, M. Ishida, T. Nakajima, Y. Honda, O. Kitao, H. Nakai, T. Vreven, J.A. Montgomery Jr., J.E. Peralta, F. Ogliaro, M. Bearpark, J.J. Heyd, E. Brothers, K.N. Kudin, V.N. Staroverov, R. Kobayashi, J. Normand, K. Raghavachari, A. Rendell, J.C. Burant, S.S. Iyengar, J. Tomasi, M. Cossi, N. Rega, J.M. Millam, M. Klene, J.E. Knox, J.B. Cross, V. Bakken, C. Adamo, J. Jaramillo, R. Gomperts, R.E. Stratmann, O. Yazyev, A.J. Austin, R. Cammi, C. Pomelli, J.W. Ochterski, R.L. Martin, K. Morokuma, V.G. Zakrzewski, G.A. Voth, P. Salvador, J.J. Dannenberg, S. Dapprich, A.D. Daniels, O. Farkas, J.B. Foresman, J.V. Ortiz, J. Cioslowski, and D.J. Fox Gaussian 09 2009 Gaussian, Inc. Wallingford, CT
53. A.D. Becke J. Chem. Phys. 98 1993 5648
54. A.D. Becke Phys. Rev. A 38 1998 3098
55. C. Lee, W. Yang, and R.G. Parr Phys. Rev. B 37 1988 785
56. R.F.W. Bader Atoms in Molecules, A Quantum Theory 1990 Oxford University Press Oxford
57. T. Lu, Multiwfn Program, Version 2.5, < http://www.multiwfn.codeplex. com >.
58. R.F.W. Bader, and H. Essén J. Chem. Phys. 80 1984 1943
59. D. Cremer, and E. Kraka Croat. Chem. Acta 57 1984 1259
60. D. Cremer, and E. Kraka Angew. Chem. Int. Engl. Ed. 23 1984 67
61. E. Espinosa, I. Alkorta, J. Elguero, and E. Molins J. Chem. Phys. 387 2004 481